Geometry & MOs

Info

ID:	200262
PubChem CID:	79374892
Reduced:	NO2C17H25 (1)
Stoich.:	AB2C17D25 (1)
Weight, g/mol:	274.142976
ΔH_f, kcal/mol:	-90.36
Dipole, Da:	3.78
IP(EA), eV:	-8.55(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[6-(ethylamino)pyridin-3-yl]methyl]-2-methoxy-6-methylpyrimidin-4-one

Drug info:

PubChemData

Smile

CC1CCCC(C1)OC2CC3=C(C2N)C=C(C=C3)OC

DOS

IR

Vibrations